CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00388203" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00388203
Family CFFBM8469 Substance-P receptor ligand 3-[bis(4-fluorophenyl)methyl]-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-one;hydrochloride family
Superfamily CFSBM4529 Substance-P receptor and Alpha-1A adrenergic receptor Binder Superfamily 2
Class CFCID944 Class 2294
External ID CHEMBL123488 External Source CHEMBL
PubChem CID 44347742 Functional Category Bioactive
Molecule Name AGN-PC-0752EO
IUPAC Name 2-hydroxybutanedioic acid;1'-[[4-(trifluoromethyl)phenyl]methyl]spiro[3,4-dihydronaphthalene-2,4'-piperidine]-1-one
Synonyms CHEBI:301899;2-hydroxybutanedioic acid;1'-[[4-(trifluoromethyl)phenyl]methyl]spiro[3,4-dihydronaphthalene-2,4'-piperidine]-1-one
InChi InChI=1S/C22H22F3NO.C4H6O5/c23-22(24,25)18-7-5-16(6-8-18)15-26-13-11-21(12-14-26)10-9-17-3-1-2-4-19(17)20(21)27;5-2(4(8)9)1-3(6)7/h1-8H,9-15H2;2,5H,1H2,(H,6,7)(H,8,9)
Formula C22H22F3NO.C4H6O5 Molecular Weight 507.50
Cross Link CHEMBL123488

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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